Ethyl Acetate → HCID 68908436, compound

HRID 2323506Notes

Reaction equation

HRID 2323506 reaction equation
[CH2:18]([CH2:19][CH3:20])[O:21][CH:22]1[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]1.[CH3:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH3:34].[CH3:35][CH2:36][O:37][C:38]([CH3:39])=[O:40].[F:1][c:2]1[cH:3][c:4]2[c:5]([cH:16][cH:17]1)[N:6]([CH2:11][CH:12]([CH2:13][I:14])[CH3:15])[C:7](=[O:10])[CH2:8][O:9]2>>[F:1][c:2]1[cH:3][c:4]2[c:5]([cH:16][cH:17]1)[N:6]([CH2:11][CH:12]([CH2:13][N:25]1[CH2:24][CH2:23][CH:22]([O:21][CH2:18][CH2:19][CH3:20])[CH2:27][CH2:26]1)[CH3:15])[C:7](=[O:10])[CH2:8][O:9]2

Participants

5

Reactant 4

HCID 8857Ethyl AcetateHCID 8900HeptaneHCID 114920374-PropoxypiperidineHCID 68915304HCID 68915304, compound

Product 1

HCID 68908436HCID 68908436, compound

Sources & evidence

ORD record
ord-d99884df81d24b039f27ab39975eb0de
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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